SCHEMBL2902596

SCHEMBL2902596

OC(CCC(F)(F)F)(Cc1ccccc1OC(F)(F)F)C1CNCCO1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 18/20 0.53
SLC6A4 P31645 6/20 0.37
CYP2D6 P10635 2/20 0.36
KCNH2 Q12809 2/20 0.36
SLC6A3 Q01959 2/20 0.35
ADRB2 P07550 1/20 0.35
HTR1A P08908 1/20 0.35
HTR2A P28223 1/20 0.35
ADRA1A P35348 1/20 0.35
HTR2B P41595 1/20 0.35
ADRA2C P18825 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL2901889 0.99 SLC6A2 (0.53) SLC6A2SLC6A4CYP2D6KCNH2SLC6A3
SCHEMBL2919619 0.89 SLC6A2 (0.56) SLC6A2SLC6A4CYP2D6KCNH2SLC6A3
Hydrochloric Acid SCHEMBL2908414 0.88 SLC6A2 (0.56) SLC6A2SLC6A4CYP2D6KCNH2SLC6A3
SCHEMBL2907000 0.86 SLC6A2 (0.55) SLC6A2SLC6A4CYP2D6KCNH2SLC6A3
Hydrochloric Acid SCHEMBL2902607 0.85 SLC6A2 (0.54) SLC6A2SLC6A4CYP2D6KCNH2SLC6A3
SCHEMBL5042325 0.83 SLC6A2 (0.77) SLC6A2SLC6A4CYP2D6KCNH2HTR1A
SCHEMBL5449237 0.83 SLC6A2 (0.77) SLC6A2SLC6A4CYP2D6KCNH2HTR1A
SCHEMBL5449233 0.83 SLC6A2 (0.77) SLC6A2SLC6A4CYP2D6KCNH2HTR1A
Hydrochloric Acid SCHEMBL5433729 0.82 SLC6A2 (0.77) SLC6A2SLC6A4CYP2D6KCNH2HTR1A
Hydrochloric Acid SCHEMBL5048021 0.82 SLC6A2 (0.77) SLC6A2SLC6A4CYP2D6KCNH2HTR1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2223916-A1 Morpholine derivatives as norepinephrine reuptake inhibitors Eli Lilly and Company (US) 2010-09-01 EP disclosed
EP-1682523-B1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS LILLY CO ELI (US) 2010-08-18 EP disclosed
EP-1682523-B1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS LILLY CO ELI (US) 2010-08-18 EP disclosed
US-7423037-B2 e.g. 1-[1,1'-biphenyl]-2-yl-2-morpholin-2-ylpropan-2-ol; antidepressant, anxiolytic agent, cognition activator ELI LILLY AND COMPANY (US) 2008-09-09 US disclosed
US-7423037-B2 e.g. 1-[1,1'-biphenyl]-2-yl-2-morpholin-2-ylpropan-2-ol; antidepressant, anxiolytic agent, cognition activator ELI LILLY AND COMPANY (US) 2008-09-09 US disclosed
US-7423037-B2 e.g. 1-[1,1'-biphenyl]-2-yl-2-morpholin-2-ylpropan-2-ol; antidepressant, anxiolytic agent, cognition activator ELI LILLY AND COMPANY (US) 2008-09-09 US disclosed
US-20070083046-A1 Morpholine derivatives as norepinephrine reuptake inhibitors ELI LILLY AND COMPANY (US) 2007-04-12 US disclosed
US-20070083046-A1 Morpholine derivatives as norepinephrine reuptake inhibitors ELI LILLY AND COMPANY (US) 2007-04-12 US disclosed
US-20070083046-A1 Morpholine derivatives as norepinephrine reuptake inhibitors ELI LILLY AND COMPANY (US) 2007-04-12 US disclosed
EP-1682523-A1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2006-07-26 EP disclosed
WO-2005047272-A1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-05-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070083046-A1 Morpholine derivatives as norepinephrine reuptake inhibitors SLC6A2, SLC18A2, SLC6A3 SLC6A2 1/4885SLC6A4 4/4885CYP2D6 109/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.